| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2008 | 23 | No |
Popular Name: (4S)-4-(3,4,5-trimethoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-one (4S)-4-(3,4,5-trimethoxyphenyl)-…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.12 | 4.21 | -11.55 | 2 | 7 | 0 | 85 | 335.385 | 4 | ↓ |
| Hi High (pH 8-9.5) | 1.30 | 3.31 | -45.65 | 1 | 7 | -1 | 87 | 334.377 | 4 | ↓ |
